5-methylsulfanyl-4-[4-[4-(phenylsulfonylamino)phenyl]-1,3-thiazol-2-yl]thiophene-2-carboximidamide

Systemtic Name: 5-methylsulfanyl-4-[4-[4-(phenylsulfonylamino)phenyl]-1,3-thiazol-2-yl]thiophene-2-carboximidamide Openeye Name: 4-[4-[4-(benzenesulfonamido)phenyl]thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[4-[4-(benzenesulfonamido)phenyl]-2-thiazolyl]-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[4-[4-(benzenesulfonamido)phenyl]-1,3-thiazol-2-yl]-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[4-[4-(benzenesulfonamido)phenyl]thiazol-2-yl]-5-(methylthio)thiophene-2-carboxamidine Formula: C21H18N4O2S4 MolecularWeight: 486.65322

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)C2=NC(=CS2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)C2=NC(=CS2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2S4/c1-28-21-16(11-18(30-21)19(22)23)20-24-17(12-29-20)13-7-9-14(10-8-13)25-31(26,27)15-5-3-2-4-6-15/h2-12,25H,1H3,(H3,22,23)